For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1,3-benzodioxole-5-propanaminium, gamma-(2-methoxyphenyl)-N-[(4-methylphenyl)methyl]-, chloride
SpectraBase Compound ID 4DfjwEACGBI
InChI InChI=1S/C25H27NO3.ClH/c1-18-7-9-19(10-8-18)16-26-14-13-21(22-5-3-4-6-23(22)27-2)20-11-12-24-25(15-20)29-17-28-24;/h3-12,15,21,26H,13-14,16-17H2,1-2H3;1H
InChIKey VKEXLVANJDTMBB-UHFFFAOYSA-N
Mol Weight 425.96 g/mol
Molecular Formula C25H28ClNO3
Exact Mass 425.175771 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID LUJZl4BV92f
Name 1,3-benzodioxole-5-propanaminium, gamma-(2-methoxyphenyl)-N-[(4-methylphenyl)methyl]-, chloride
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C25H27NO3.ClH/c1-18-7-9-19(10-8-18)16-26-14-13-21(22-5-3-4-6-23(22)27-2)20-11-12-24-25(15-20)29-17-28-24;/h3-12,15,21,26H,13-14,16-17H2,1-2H3;1H
InChIKey VKEXLVANJDTMBB-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_3569
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: NMR/11278548